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Ethyl 7-chloro-2-oxoheptanoate

CAS No.
78834-75-0
Chemical Name:
Ethyl 7-chloro-2-oxoheptanoate
Synonyms
ECO;7-Chloro-2-oxoheptanoic acid ethyl ester;MGC46090;Cilastatin Intermediate 1;ICK, active, GST tagged human;Ethyl 7-chloro-2-oxohepanoate;Ethyl 7-Chloro-2-Otoheptanoate;ETHYL 7-CHLORO-2-OXOHEPTANOATE;Ethyl 7-chloro-2-oxo-heptanate;Ethyl -7-chloro-2-oxo heptonate
CBNumber:
CB2118774
Molecular Formula:
C9H15ClO3
Molecular Weight:
206.67
MDL Number:
MFCD07698675
MOL File:
78834-75-0.mol
MSDS File:
SDS
Last updated:2026-05-27 23:54:43
Product description Number Pack Size Price
Ethyl 7-chloro-2-oxoheptanoate CDS020993 100 mg $39.1
ICK, active, GST tagged human PRECISIO? Kinase, recombinant, expressed in baculovirus infected Sf9 cells, ≥70% (SDS-PAGE), buffered aqueous glycerol solution SRP5039 10μG $502
Ethyl 7-Chloro-2-oxoheptanoate >98.0%(GC) E0827 5g $46
Ethyl 7-Chloro-2-oxoheptanoate >98.0%(GC) E0827 25g $139
Ethyl 7-Chloro-2-oxoheptanoate TRC-E901785-5G 5g $109
More product size

Ethyl 7-chloro-2-oxoheptanoate Properties

Boiling point 281.2±23.0 °C(Predicted)
Density 1.093±0.06 g/cm3(Predicted)
refractive index 1.4510 to 1.4560
storage temp. Inert atmosphere,2-8°C
solubility Acetonitrile (Slightly), Chloroform (Slightly), Ethyl Acetate (Slightly)
form Liquid
color Clear Yellow
InChI InChI=1S/C9H15ClO3/c1-2-13-9(12)8(11)6-4-3-5-7-10/h2-7H2,1H3
InChIKey YJJLIIMRHGRCFM-UHFFFAOYSA-N
SMILES C(OCC)(=O)C(=O)CCCCCCl
CAS DataBase Reference 78834-75-0(CAS DataBase Reference)
UNSPSC Code 12352200
NACRES NA.21

SAFETY

Risk and Safety Statements

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H335-H302-H332-H319-H315
Precautionary statements  P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501-P261-P271-P304+P340-P312
WGK Germany  WGK 3
HS Code  2918300090
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral
REACH Registrations Active

Ethyl 7-chloro-2-oxoheptanoate price More Price(51)

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
Sigma-Aldrich CDS020993 Ethyl 7-chloro-2-oxoheptanoate 78834-75-0 100 mg $39.1 2026-04-30 Buy
Sigma-Aldrich SRP5039 ICK, active, GST tagged human PRECISIO? Kinase, recombinant, expressed in baculovirus infected Sf9 cells, ≥70% (SDS-PAGE), buffered aqueous glycerol solution 78834-75-0 10μG $502 2023-06-20 Buy
TCI Chemical E0827 Ethyl 7-Chloro-2-oxoheptanoate >98.0%(GC) 78834-75-0 5g $46 2026-04-30 Buy
TCI Chemical E0827 Ethyl 7-Chloro-2-oxoheptanoate >98.0%(GC) 78834-75-0 25g $139 2026-04-30 Buy
TRC TRC-E901785-5G Ethyl 7-Chloro-2-oxoheptanoate 78834-75-0 5g $109 2026-06-03 Buy
Product number Packaging Price Buy
CDS020993 100 mg $39.1 Buy
SRP5039 10μG $502 Buy
E0827 5g $46 Buy
E0827 25g $139 Buy
TRC-E901785-5G 5g $109 Buy

Ethyl 7-chloro-2-oxoheptanoate Chemical Properties,Uses,Production

Chemical Properties

Colorless to Light orange to Yellow clear liquid.

Uses

Ethyl 7-Chloro-2-oxoheptanoate is a reagent used in the synthesis of selective BCL-XL inhibitor A1155463 used in the treatment of cancer.

Uses

Ethyl 7-chloro-2-oxoheptanoate is a product of the Grignard reaction that can be used to synthesize organic compounds. It has been used in the preparation of pharmaceuticals such as cilastatin, which is used to inhibit cytochrome P450 enzymes in order to prolong the effectiveness of other drugs. This reagent also reacts with hydrochloric acid to form ethyl chloride and heptanoic acid, which can be used for chlorination reactions.

Preparation

Ethyl 7-chloro-2-oxoheptanoate is an organochlorine compound that is obtained by reacting ethyl chloride with magnesium in the presence of benzene and cilastatin as a catalyst.

Synthesis

1-Bromo-5-chloropentane

54512-75-3

Diethyl oxalate

95-92-1

Ethyl 7-chloro-2-oxoheptanoate

78834-75-0

The general procedure for the synthesis of ethyl 7-chloro-2-oxoheptanoate from 1-bromo-5-chloropentane and diethyl oxalate is as follows (Example 1): 1. Reaction apparatus preparation: the reaction apparatus 10 shown in Figure 1 was used, wherein the main flow channel 12 was a circular tube made of stainless steel, and the introduction points 12o and 12p were 180-degree T-shaped mixture flow channels. 2. Grignard reagent preparation: 1-bromo-magnesium-5-chloropentane Grignard reagent (0.45 mol/L) was prepared by adding magnesium powder to 1-bromo-5-chloropentane and diluted with tetrahydrofuran solvent, and the resulting diluted solution was used as feedstock M2. 3. Raw material preparation: Undiluted diethyl oxalate (7.4 mol/L) was used as raw material M1. 4. Reactant delivery: Feedstock M2 and feedstock M1 were delivered to a flow-type microfine reaction flow path 32 via smooth flow pumps 20 and 26 manufactured by TACMINA CORPORATION at flow rates of 110 mL/min and 5.1 mL/min, respectively. 5. Control of reaction conditions: Feedstock M2 (Grignard reagent) and feedstock M1 (diethyl oxalate) were controlled at 10 °C and room temperature, respectively, and the thermostatic liquid tank 28 was charged with methanol as refrigerant 30 and controlled at -15 °C. 6. Reaction process: Under the above conditions, the residence time of the reactants in the flow-type fine reaction flow channel 32 was about 14 seconds. 7. Product treatment: The liquid from the reaction was collected and the reaction was quenched with dilute hydrochloric acid to give the target product ethyl-7-chloro-2-pentyl oxalate in 90% yield.

References

[1] Patent: EP2065354, 2009, A1. Location in patent: Page/Page column 11-12
[2] Patent: WO2006/22511, 2006, A1. Location in patent: Page/Page column 10-11

54512-75-3
95-92-1
78834-75-0
Synthesis of Ethyl 7-chloro-2-oxoheptanoate from 1-Bromo-5-chloropentane and Diethyl oxalate
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View Lastest Price from Ethyl 7-chloro-2-oxoheptanoate manufacturers

Image Update time Product Price Min. Order Purity Supply Ability Manufacturer
Ethyl 7-chloro-2-oxoheptanoate pictures 2026-03-20 Ethyl 7-chloro-2-oxoheptanoate
78834-75-0
$10.00 1KG 99% 100 mt Hebei Chuanghai Biotechnology Co., Ltd
Ethyl-7-Chloro-2-Oxo-Heptanoate pictures 2025-06-20 Ethyl-7-Chloro-2-Oxo-Heptanoate
78834-75-0
1kg 98.00% 20tons Hebei Yanxi Chemical Co., Ltd.
Ethyl 7-chloro-2-oxoheptanoate Synonyms pictures 2023-05-31 Ethyl 7-chloro-2-oxoheptanoate Synonyms
78834-75-0
$28.00-30.00 1Kg 99.0% up 50 tons per month Xinxiang Hongqi District Houyuan Trading Co.,Ltd

Ethyl 7-chloro-2-oxoheptanoate Spectrum

7-Chloro-2-oxoheptanoic acid ethyl ester Ethyl 7-chloro-2-oxohepanoate ETHYL 7-CHLORO-2-OXOHEPTANOATE Ethyl 7-Chloro-2-Otoheptanoate ALPHA KETO ESTER (ETHYL 7-CHLORO-2-OXOHEPTANOATE) Heptanoic acid,7-chloro-2-oxo-, ethyl ester ICK, active, GST tagged human MGC46090 Ethyl -7-chloro-2-oxo heptonate Ethyl7-Chloro-2-oxoheptanoate> Recombinant E. coli Ecotin Protein, His Tag Ethyl 7-chloro-2-oxo-heptanate Ethyl 7-chloro-2-oxoheptanoate Synonyms Cilastatin Intermediate 1 ECO 78834-75-0 C9H15ClO3 API bc0001